#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ksm h ALA 74 N 0.00 1.00 -3.77 4.61 0.00 -2.09 -3.46 119.26 115.55 2ksm h ALA 74 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.74 2ksm h ALA 74 Cb 0.00 0.00 0.05 0.00 0.00 0.00 0.00 17.79 17.84 2ksm h ALA 74 CO 0.00 0.00 0.11 -1.13 0.00 0.00 0.00 179.25 178.23 2ksm n SER 75 N -3.09 0.24 -4.69 0.00 3.41 -1.26 -5.01 113.62 103.22 2ksm n SER 75 Ca 0.04 -1.30 -0.42 0.00 -0.26 0.00 0.00 58.87 56.93 2ksm n SER 75 Cb 0.50 -0.34 -0.03 0.00 -0.26 0.00 0.00 64.21 64.08 2ksm n SER 75 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ksm s ALA 76 N -3.55 3.45 0.02 7.33 0.00 -1.26 -4.93 121.76 122.82 2ksm s ALA 76 Ca 0.28 0.60 -0.19 0.00 0.00 0.00 0.00 51.96 52.65 2ksm s ALA 76 Cb -0.01 -3.48 -0.22 0.00 0.00 0.00 0.00 23.12 19.41 2ksm s ALA 76 CO 0.19 -0.67 1.14 1.25 0.00 0.00 0.00 175.76 177.68 2ksm h LEU 77 N 7.94 0.57 0.00 0.00 5.85 -1.94 -3.47 115.31 124.24 2ksm h LEU 77 Ca -0.35 -0.72 0.00 0.00 0.84 0.00 0.00 57.88 57.65 2ksm h LEU 77 Cb 1.17 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 42.03 2ksm h LEU 77 CO 0.86 1.21 0.00 -1.20 -0.34 0.00 0.00 178.44 178.97 2ksm n SER 78 N -4.22 1.42 -3.64 1.25 7.64 -1.26 -5.06 113.62 109.74 2ksm n SER 78 Ca -0.10 0.00 -0.15 0.00 1.01 0.00 0.00 58.87 59.64 2ksm n SER 78 Cb 0.65 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.78 2ksm n SER 78 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 2ksm s LEU 79 N 0.00 -0.21 0.27 -3.43 2.34 -1.26 -4.68 118.68 111.71 2ksm s LEU 79 Ca 0.00 0.88 -0.21 0.00 0.06 0.00 0.00 54.13 54.86 2ksm s LEU 79 Cb 0.00 2.07 0.04 0.00 -0.56 0.00 0.00 46.19 47.74 2ksm s LEU 79 CO 0.00 -0.37 0.80 -0.55 -1.06 0.00 0.00 176.35 175.17 2ksm s SER 80 N -0.40 -0.18 0.27 1.48 0.15 -1.26 -4.58 113.70 109.19 2ksm s SER 80 Ca -0.05 -0.67 0.10 0.00 0.70 0.00 0.00 55.95 56.02 2ksm s SER 80 Cb -0.03 0.69 -0.04 0.00 -1.71 0.00 0.00 66.02 64.93 2ksm s SER 80 CO 0.04 -1.31 -0.02 -0.76 1.20 0.00 0.00 173.24 172.39 2ksm s LEU 81 N -2.98 3.11 0.03 3.45 1.02 -1.26 -4.06 118.68 117.99 2ksm s LEU 81 Ca 0.13 -0.72 0.03 0.00 0.02 0.00 0.00 54.13 53.59 2ksm s LEU 81 Cb -0.05 -1.62 -0.02 0.00 0.02 0.00 0.00 46.19 44.53 2ksm s LEU 81 CO 0.07 -0.02 -0.09 -0.22 0.02 0.00 0.00 176.35 176.11 2ksm s LEU 82 N -3.66 2.18 -0.04 1.79 2.96 -0.21 -4.56 118.68 117.14 2ksm s LEU 82 Ca 0.32 -0.42 -0.01 0.00 -0.22 0.00 0.00 54.13 53.79 2ksm s LEU 82 Cb -0.06 -0.34 0.03 0.00 0.50 0.00 0.00 46.19 46.32 2ksm s LEU 82 CO 0.19 -0.07 0.05 -0.55 -1.32 0.00 0.00 176.35 174.65 2ksm s SER 83 N -1.13 0.94 -0.04 3.68 0.15 -1.15 -2.32 113.70 113.84 2ksm s SER 83 Ca -0.03 0.05 0.02 0.00 0.70 0.00 0.00 55.95 56.68 2ksm s SER 83 Cb -0.08 -0.16 0.01 0.00 -1.71 0.00 0.00 66.02 64.09 2ksm s SER 83 CO 0.01 -0.21 -0.08 -0.63 1.20 0.00 0.00 173.24 173.53 2ksm s ILE 84 N 1.88 0.74 -0.05 6.45 1.01 -0.54 -2.17 121.20 128.51 2ksm s ILE 84 Ca 0.02 -0.28 0.02 0.00 0.00 0.00 0.00 60.65 60.40 2ksm s ILE 84 Cb -0.12 -0.70 0.01 0.00 0.01 0.00 0.00 42.46 41.66 2ksm s ILE 84 CO -0.03 0.25 -0.11 -0.55 0.00 0.00 0.00 174.94 174.50 2ksm s SER 85 N 0.55 1.60 -0.17 3.58 0.15 0.67 -2.28 113.70 117.81 2ksm s SER 85 Ca -0.09 -0.26 -0.03 0.00 0.70 0.00 0.00 55.95 56.27 2ksm s SER 85 Cb -0.12 -0.68 0.05 0.00 -1.71 0.00 0.00 66.02 63.56 2ksm s SER 85 CO 0.01 0.04 0.03 -0.60 1.20 0.00 0.00 173.24 173.92 2ksm s ARG 86 N 0.57 0.62 -0.01 5.44 3.52 -1.08 -1.44 118.95 126.56 2ksm s ARG 86 Ca -0.12 -0.31 0.12 0.00 -0.13 0.00 0.00 55.73 55.29 2ksm s ARG 86 Cb -0.14 -1.90 -0.18 0.00 -1.56 0.00 0.00 34.95 31.17 2ksm s ARG 86 CO 0.03 -0.58 0.28 0.45 -0.81 0.00 0.00 175.30 174.66 2ksm n SER 87 N 5.08 2.16 0.00 -2.12 2.88 -0.40 -2.24 113.62 118.98 2ksm n SER 87 Ca -0.09 -0.08 0.00 0.00 -1.33 0.00 0.00 58.87 57.38 2ksm n SER 87 Cb 0.48 1.48 0.00 0.00 -0.75 0.00 0.00 64.21 65.42 2ksm n SER 87 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ksm n GLY 88 N 1.78 1.97 0.00 0.46 0.00 -0.79 -4.40 105.19 104.21 2ksm n GLY 88 Ca -0.02 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.37 2ksm n GLY 88 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2ksm n ASN 89 N 0.00 0.00 -4.74 1.61 4.05 -1.26 -4.60 115.26 110.32 2ksm n ASN 89 Ca 0.00 0.95 -0.25 0.00 0.45 0.00 0.00 54.58 55.73 2ksm n ASN 89 Cb 0.00 -0.45 -0.06 0.00 1.23 0.00 0.00 39.78 40.50 2ksm n ASN 89 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 177.26 174.63 2ksm s THR 90 N -2.80 4.10 -0.04 -0.44 -4.23 -1.26 -2.95 115.64 108.02 2ksm s THR 90 Ca 0.00 -1.34 0.05 0.00 -1.18 0.00 0.00 61.69 59.22 2ksm s THR 90 Cb 0.00 -3.11 -0.01 0.00 1.34 0.00 0.00 72.50 70.72 2ksm s THR 90 CO 0.00 -0.17 -0.17 -0.69 -0.54 0.00 0.00 174.62 173.04 2ksm s VAL 91 N -1.86 1.44 -0.20 2.29 1.01 -1.11 -3.76 120.40 118.21 2ksm s VAL 91 Ca 0.30 -0.73 0.01 0.00 0.00 0.00 0.00 61.98 61.56 2ksm s VAL 91 Cb -0.09 -1.23 0.03 0.00 0.00 0.00 0.00 36.38 35.09 2ksm s VAL 91 CO 0.22 0.41 -0.16 -0.89 0.00 0.00 0.00 175.10 174.68 2ksm s THR 92 N -0.04 2.00 -0.08 3.92 2.01 -0.52 -1.24 115.64 121.69 2ksm s THR 92 Ca -0.02 -1.11 -0.01 0.00 0.31 0.00 0.00 61.69 60.86 2ksm s THR 92 Cb -0.11 -1.93 0.03 0.00 0.01 0.00 0.00 72.50 70.50 2ksm s THR 92 CO 0.02 0.34 -0.01 -0.22 -0.69 0.00 0.00 174.62 174.05 2ksm s LEU 93 N 1.27 0.70 0.09 4.42 2.96 -1.04 -0.24 118.68 126.84 2ksm s LEU 93 Ca 0.01 -0.12 0.04 0.00 -0.22 0.00 0.00 54.13 53.83 2ksm s LEU 93 Cb -0.15 -0.51 -0.03 0.00 0.50 0.00 0.00 46.19 45.99 2ksm s LEU 93 CO -0.10 -0.18 -0.11 0.27 -1.32 0.00 0.00 176.35 174.91 2ksm s ILE 94 N 1.91 0.96 -5.00 6.68 -4.36 -0.92 -1.45 121.20 119.02 2ksm s ILE 94 Ca 0.05 -1.51 0.00 0.00 -0.26 0.00 0.00 60.65 58.93 2ksm s ILE 94 Cb -0.12 -1.22 0.00 0.00 1.25 0.00 0.00 42.46 42.37 2ksm s ILE 94 CO -0.06 -0.45 0.00 0.61 0.24 0.00 0.00 174.94 175.28 2ksm n GLY 95 N 0.82 0.39 2.93 6.27 0.00 -1.24 -2.92 105.19 111.44 2ksm n GLY 95 Ca -0.18 -1.44 -0.16 0.00 0.00 0.00 0.00 46.02 44.24 2ksm n GLY 95 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2ksm s ASP 96 N -4.00 0.60 0.26 1.61 1.11 -1.26 -2.84 116.67 112.15 2ksm s ASP 96 Ca 0.00 -0.09 0.10 0.00 0.18 0.00 0.00 52.55 52.74 2ksm s ASP 96 Cb 0.00 -0.13 -0.04 0.00 1.07 0.00 0.00 42.92 43.82 2ksm s ASP 96 CO 0.00 0.03 -0.02 -0.36 1.18 0.00 0.00 175.17 176.00 2ksm s PHE 97 N 0.13 2.67 0.04 4.23 0.40 0.16 -4.70 117.98 120.91 2ksm s PHE 97 Ca -0.01 -0.23 -0.17 0.00 -0.60 0.00 0.00 56.93 55.92 2ksm s PHE 97 Cb -0.05 -1.19 -0.24 0.00 0.51 0.00 0.00 43.02 42.06 2ksm s PHE 97 CO -0.00 0.62 1.13 -1.00 0.70 0.00 0.00 175.22 176.67 2ksm h PRO 98 N 1.94 0.55 0.00 0.24 0.13 -1.83 -0.98 132.00 132.06 2ksm h PRO 98 Ca -0.44 -0.61 -0.34 0.00 -0.87 0.00 0.00 66.00 63.75 2ksm h PRO 98 Cb 1.25 0.18 -0.08 0.00 0.13 0.00 0.00 31.00 32.47 2ksm h PRO 98 CO 0.60 1.22 -0.31 -3.47 -0.23 0.00 0.00 178.00 175.82 2ksm n ASP 99 N -4.03 0.12 -0.10 1.44 -0.08 -1.26 -3.75 116.55 108.89 2ksm n ASP 99 Ca -0.11 -2.45 -0.12 0.00 -1.51 0.00 0.00 54.79 50.60 2ksm n ASP 99 Cb 0.79 0.95 -0.15 0.00 2.34 0.00 0.00 41.12 45.05 2ksm n ASP 99 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 2ksm n GLU 100 N -0.49 0.68 0.27 -0.67 -0.58 -1.26 -4.23 120.64 114.36 2ksm n GLU 100 Ca 0.02 0.05 0.10 0.00 -0.42 0.00 0.00 57.16 56.91 2ksm n GLU 100 Cb 0.40 -1.55 0.71 0.00 -0.57 0.00 0.00 31.44 30.44 2ksm n GLU 100 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2ksm h ALA 101 N 0.77 1.78 -0.40 0.62 0.00 -2.03 -1.06 119.26 118.95 2ksm h ALA 101 Ca -0.53 -0.03 0.12 0.00 0.00 0.00 0.00 54.91 54.47 2ksm h ALA 101 Cb 2.16 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.92 2ksm h ALA 101 CO 0.01 0.04 0.42 0.00 0.00 0.00 0.00 179.25 179.71 2ksm h ALA 102 N 1.97 2.12 -0.31 0.00 0.00 -2.00 0.27 119.26 121.31 2ksm h ALA 102 Ca -0.00 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 2ksm h ALA 102 Cb 0.06 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2ksm h ALA 102 CO 0.00 -0.62 -0.24 1.57 0.00 0.00 0.00 179.25 179.96 2ksm h LYS 103 N 0.00 0.60 -0.93 0.00 2.10 -1.45 -2.99 116.57 113.90 2ksm h LYS 103 Ca 0.19 -0.23 0.03 0.00 -2.00 0.00 0.00 60.65 58.64 2ksm h LYS 103 Cb 1.02 -0.03 -0.05 0.00 -0.90 0.00 0.00 32.23 32.27 2ksm h LYS 103 CO -0.00 0.79 0.61 0.00 -2.00 0.00 0.00 179.45 178.85 2ksm h ALA 104 N 1.22 1.40 -0.50 0.07 0.00 -0.61 0.82 119.26 121.66 2ksm h ALA 104 Ca 0.08 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 2ksm h ALA 104 Cb 0.69 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2ksm h ALA 104 CO 0.05 0.51 -0.12 0.00 0.00 0.00 0.00 179.25 179.69 2ksm h ALA 105 N 1.45 0.84 0.02 0.00 0.00 -1.57 -2.69 119.26 117.31 2ksm h ALA 105 Ca 0.37 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 2ksm h ALA 105 Cb 0.00 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 17.61 2ksm h ALA 105 CO -0.11 0.65 -0.22 1.25 0.00 0.00 0.00 179.25 180.82 2ksm h LEU 106 N 0.83 0.15 -0.90 0.00 6.46 -1.38 -3.30 115.31 117.17 2ksm h LEU 106 Ca 0.13 -0.89 0.24 0.00 -0.12 0.00 0.00 57.88 57.24 2ksm h LEU 106 Cb 0.66 -0.05 -0.16 0.00 -0.73 0.00 0.00 40.66 40.38 2ksm h LEU 106 CO 0.05 1.02 0.07 0.24 -0.62 0.00 0.00 178.44 179.20 2ksm h MET 107 N -0.70 0.07 -0.67 1.25 2.86 0.64 1.52 114.93 119.90 2ksm h MET 107 Ca -0.03 -0.00 0.19 0.00 -2.06 0.00 0.00 59.70 57.80 2ksm h MET 107 Cb 1.08 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 32.69 2ksm h MET 107 CO 0.04 0.05 0.82 1.15 1.06 0.00 0.00 176.91 180.03 2ksm h THR 108 N 0.08 0.16 0.12 2.22 2.02 -1.55 1.68 112.91 117.64 2ksm h THR 108 Ca 0.54 0.00 -0.28 0.00 0.77 0.00 0.00 66.41 67.44 2ksm h THR 108 Cb 1.08 0.32 0.00 0.00 -1.74 0.00 0.00 68.15 67.82 2ksm h THR 108 CO -0.80 0.00 -1.34 0.00 0.37 0.00 0.00 175.52 173.75 2ksm h ALA 109 N 0.98 0.16 -0.60 6.16 0.00 0.20 -3.31 119.26 122.86 2ksm h ALA 109 Ca 0.32 -0.96 -0.01 0.00 0.00 0.00 0.00 54.91 54.25 2ksm h ALA 109 Cb 1.96 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 19.82 2ksm h ALA 109 CO -0.00 1.03 0.33 -0.07 0.00 0.00 0.00 179.25 180.54 2ksm h LEU 110 N 0.07 0.74 -0.41 0.00 4.07 0.26 -1.88 115.31 118.16 2ksm h LEU 110 Ca -0.17 -0.09 0.00 0.00 0.08 0.00 0.00 57.88 57.70 2ksm h LEU 110 Cb 1.99 -0.19 0.00 0.00 1.08 0.00 0.00 40.66 43.54 2ksm h LEU 110 CO 0.19 0.62 0.84 -1.13 -1.08 0.00 0.00 178.44 177.89 2ksm h ASN 111 N 0.81 0.00 0.56 -0.43 -0.00 -1.44 2.21 115.58 117.29 2ksm h ASN 111 Ca 0.21 0.00 -0.28 0.00 -0.00 0.00 0.00 56.30 56.23 2ksm h ASN 111 Cb 0.04 0.00 -0.03 0.00 -0.00 0.00 0.00 38.32 38.33 2ksm h ASN 111 CO -0.03 0.00 -1.51 1.23 -0.00 0.00 0.00 177.43 177.12 2ksm h GLY 112 N 0.00 0.12 0.78 1.57 0.00 -1.53 -3.35 103.07 100.66 2ksm h GLY 112 Ca 0.00 -0.31 -0.20 0.00 0.00 0.00 0.00 47.33 46.82 2ksm h GLY 112 CO 0.00 0.27 -1.63 -0.10 0.00 0.00 0.00 176.54 175.08 2ksm n LEU 113 N -3.29 0.69 -4.30 3.11 -0.00 0.70 -4.91 117.00 109.00 2ksm n LEU 113 Ca -0.14 0.31 -0.56 0.00 -0.00 0.00 0.00 56.01 55.61 2ksm n LEU 113 Cb 1.02 0.14 -0.12 0.00 -0.00 0.00 0.00 43.42 44.46 2ksm n LEU 113 CO 0.47 0.22 1.82 -0.11 -0.00 0.00 0.00 177.39 179.79 2ksm n LEU 114 N -2.85 0.70 -4.61 -1.96 -0.00 0.15 -4.90 117.00 103.54 2ksm n LEU 114 Ca -0.14 0.59 -0.24 0.00 -0.00 0.00 0.00 56.01 56.22 2ksm n LEU 114 Cb 0.90 -0.91 -0.09 0.00 -0.00 0.00 0.00 43.42 43.32 2ksm n LEU 114 CO 0.43 -0.76 -0.33 0.00 -0.00 0.00 0.00 177.39 176.73 2ksm s ALA 115 N 6.56 3.12 -0.16 1.96 0.00 -1.26 -5.01 121.76 126.97 2ksm s ALA 115 Ca 1.23 -1.90 -0.29 0.00 0.00 0.00 0.00 51.96 50.99 2ksm s ALA 115 Cb -1.44 -0.42 -0.03 0.00 0.00 0.00 0.00 23.12 21.23 2ksm s ALA 115 CO 0.63 0.13 1.53 -1.25 0.00 0.00 0.00 175.76 176.80 2ksm s PRO 116 N -3.68 4.02 0.00 0.00 0.04 -1.26 -2.30 135.00 131.82 2ksm s PRO 116 Ca 0.33 1.80 0.00 0.00 0.04 0.00 0.00 61.00 63.18 2ksm s PRO 116 Cb -0.02 -3.95 0.00 0.00 0.04 0.00 0.00 34.50 30.57 2ksm s PRO 116 CO 0.19 -1.02 0.00 0.41 0.04 0.00 0.00 177.00 176.62 2ksm n GLY 117 N 4.25 0.74 3.72 0.56 0.00 -1.26 -5.04 105.19 108.16 2ksm n GLY 117 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2ksm n GLY 117 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ksm s VAL 118 N -2.34 4.31 -0.12 1.61 0.11 -0.97 -5.04 120.40 117.97 2ksm s VAL 118 Ca 0.00 1.78 -0.05 0.00 -2.93 0.00 0.00 61.98 60.78 2ksm s VAL 118 Cb 0.00 -4.14 -0.04 0.00 -1.53 0.00 0.00 36.38 30.67 2ksm s VAL 118 CO 0.00 0.21 0.08 0.21 -3.33 0.00 0.00 175.10 172.27 2ksm s ASN 119 N 0.54 5.90 -0.04 3.54 2.47 -1.15 -4.92 114.94 121.27 2ksm s ASN 119 Ca 0.52 0.31 0.06 0.00 0.42 0.00 0.00 52.86 54.16 2ksm s ASN 119 Cb -0.26 -1.85 -0.02 0.00 -1.45 0.00 0.00 41.25 37.67 2ksm s ASN 119 CO 0.30 0.37 -0.21 -0.69 -3.72 0.00 0.00 177.10 173.15 2ksm s VAL 120 N -0.78 2.46 -0.48 -5.21 1.01 -1.26 -2.73 120.40 113.41 2ksm s VAL 120 Ca 0.13 -0.94 0.05 0.00 0.00 0.00 0.00 61.98 61.21 2ksm s VAL 120 Cb -0.12 -1.91 0.18 0.00 0.00 0.00 0.00 36.38 34.53 2ksm s VAL 120 CO 0.03 0.58 0.41 -0.38 0.00 0.00 0.00 175.10 175.74 2ksm n ILE 121 N 2.56 -0.40 -4.02 2.22 -0.00 -0.37 -4.93 119.36 114.42 2ksm n ILE 121 Ca -0.17 -3.87 -0.34 0.00 -0.00 0.00 0.00 62.75 58.37 2ksm n ILE 121 Cb 0.52 -1.82 -0.15 0.00 -0.00 0.00 0.00 39.64 38.19 2ksm n ILE 121 CO 0.00 0.00 0.00 1.51 -0.00 0.00 0.00 176.55 178.06 2ksm s ASP 122 N -0.51 4.01 -0.29 4.38 -4.77 -1.26 -2.51 116.67 115.72 2ksm s ASP 122 Ca 0.32 -0.89 0.03 0.00 -3.30 0.00 0.00 52.55 48.70 2ksm s ASP 122 Cb 0.04 -1.59 0.08 0.00 -1.09 0.00 0.00 42.92 40.36 2ksm s ASP 122 CO -0.18 -0.10 -0.02 -1.10 0.70 0.00 0.00 175.17 174.47 2ksm s GLN 123 N 1.28 1.71 0.00 2.11 -1.52 -0.52 -4.98 119.66 117.75 2ksm s GLN 123 Ca -0.00 -1.46 0.08 0.00 -1.95 0.00 0.00 55.36 52.03 2ksm s GLN 123 Cb -0.16 -2.88 -0.02 0.00 -0.22 0.00 0.00 33.01 29.72 2ksm s GLN 123 CO -0.07 -0.75 -0.25 0.42 -0.25 0.00 0.00 175.29 174.40 2ksm s ILE 124 N 1.12 1.97 0.12 1.08 1.01 -1.26 -3.68 121.20 121.56 2ksm s ILE 124 Ca 0.01 -1.15 0.03 0.00 0.00 0.00 0.00 60.65 59.54 2ksm s ILE 124 Cb -0.19 -1.65 -0.04 0.00 0.01 0.00 0.00 42.46 40.59 2ksm s ILE 124 CO -0.08 0.47 0.15 -1.00 0.00 0.00 0.00 174.94 174.48 2ksm s HIS 125 N -0.66 3.27 0.15 3.97 3.76 -1.13 -4.86 115.29 119.79 2ksm s HIS 125 Ca 0.10 0.07 -0.16 0.00 -0.15 0.00 0.00 55.06 54.92 2ksm s HIS 125 Cb -0.10 -1.60 -0.07 0.00 1.11 0.00 0.00 32.58 31.92 2ksm s HIS 125 CO 0.00 0.53 0.59 0.08 -0.85 0.00 0.00 174.74 175.09 2ksm s VAL 126 N -1.60 4.78 -0.51 -0.90 1.01 -1.26 0.40 120.40 122.31 2ksm s VAL 126 Ca 0.32 0.98 0.07 0.00 0.00 0.00 0.00 61.98 63.34 2ksm s VAL 126 Cb -0.11 -3.78 0.19 0.00 0.00 0.00 0.00 36.38 32.68 2ksm s VAL 126 CO 0.24 0.28 0.75 0.47 0.00 0.00 0.00 175.10 176.84 2ksm n ASP 127 N 0.92 -3.39 0.00 3.32 8.00 -0.37 -4.90 116.55 120.13 2ksm n ASP 127 Ca -0.05 -2.87 0.00 0.00 0.71 0.00 0.00 54.79 52.58 2ksm n ASP 127 Cb 0.51 1.73 0.00 0.00 -0.02 0.00 0.00 41.12 43.34 2ksm n ASP 127 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 2ksm n PRO 128 N 2.89 0.00 -0.09 -0.24 -0.02 -1.25 -1.68 135.00 134.62 2ksm n PRO 128 Ca 0.18 0.00 -0.17 0.00 -2.02 0.00 0.00 63.50 61.49 2ksm n PRO 128 Cb 0.56 -1.31 -0.07 0.00 -0.02 0.00 0.00 33.50 32.66 2ksm n PRO 128 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2ksm n VAL 129 N -0.63 0.96 -0.25 -1.45 0.31 -1.26 -5.02 118.33 110.98 2ksm n VAL 129 Ca 0.00 -0.28 0.00 0.00 -0.01 0.00 0.00 64.34 64.05 2ksm n VAL 129 Cb 0.00 -1.55 0.00 0.00 -0.91 0.00 0.00 33.84 31.38 2ksm n VAL 129 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 2ksm n VAL 130 N -3.55 0.00 -3.89 2.52 0.24 -0.68 -4.50 118.33 108.48 2ksm n VAL 130 Ca -0.33 0.00 -0.10 0.00 -2.04 0.00 0.00 64.34 61.87 2ksm n VAL 130 Cb 0.76 -0.66 -0.10 0.00 -1.47 0.00 0.00 33.84 32.38 2ksm n VAL 130 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 2ksm s ARG 131 N -2.31 0.53 0.18 7.34 1.81 -1.26 -4.69 118.95 120.55 2ksm s ARG 131 Ca 0.00 -0.54 0.01 0.00 -1.72 0.00 0.00 55.73 53.48 2ksm s ARG 131 Cb 0.00 0.22 -0.05 0.00 -0.45 0.00 0.00 34.95 34.67 2ksm s ARG 131 CO 0.00 -0.13 0.04 0.45 -0.68 0.00 0.00 175.30 174.97 2ksm s SER 132 N -1.69 1.00 0.47 0.23 0.15 -1.26 -3.99 113.70 108.61 2ksm s SER 132 Ca -0.11 -1.23 -0.25 0.00 0.70 0.00 0.00 55.95 55.06 2ksm s SER 132 Cb -0.05 0.17 -0.08 0.00 -1.71 0.00 0.00 66.02 64.35 2ksm s SER 132 CO -0.01 -0.64 1.43 -0.22 1.20 0.00 0.00 173.24 175.00 2ksm s LEU 133 N -3.18 4.07 -0.74 3.45 2.96 -1.26 -4.91 118.68 119.07 2ksm s LEU 133 Ca 0.27 2.93 -0.24 0.00 -0.22 0.00 0.00 54.13 56.88 2ksm s LEU 133 Cb 0.07 -3.98 0.06 0.00 0.50 0.00 0.00 46.19 42.84 2ksm s LEU 133 CO 0.06 -1.27 1.12 -1.81 -1.32 0.00 0.00 176.35 173.13 2ksm s ASP 134 N -0.54 6.24 0.00 3.68 1.11 -1.26 -4.83 116.67 121.07 2ksm s ASP 134 Ca 0.63 -0.96 0.22 0.00 0.18 0.00 0.00 52.55 52.62 2ksm s ASP 134 Cb -0.44 -2.47 0.73 0.00 1.07 0.00 0.00 42.92 41.81 2ksm s ASP 134 CO 0.56 -1.54 1.55 2.22 1.18 0.00 0.00 175.17 179.14 2ksm n PHE 135 N 8.23 0.21 -0.59 4.23 1.16 -1.26 -4.32 117.46 125.12 2ksm n PHE 135 Ca 0.04 -0.10 0.47 0.00 -1.87 0.00 0.00 57.45 55.99 2ksm n PHE 135 Cb 0.47 0.00 0.78 0.00 -1.61 0.00 0.00 39.48 39.12 2ksm n PHE 135 CO 0.00 0.00 0.00 0.66 -1.87 0.00 0.00 176.76 175.55 2ksm h SER 136 N 2.55 0.05 -0.54 5.98 4.64 -1.94 2.13 113.55 126.42 2ksm h SER 136 Ca 0.00 0.03 -0.36 0.00 -0.47 0.00 0.00 61.79 60.99 2ksm h SER 136 Cb 0.56 0.03 -0.24 0.00 -0.31 0.00 0.00 62.40 62.44 2ksm h SER 136 CO 0.00 -0.04 -0.27 -1.54 -0.87 0.00 0.00 176.83 174.11 2ksm n SER 137 N -4.14 3.95 0.16 4.97 3.41 -1.26 -4.54 113.62 116.17 2ksm n SER 137 Ca 0.40 -3.80 0.10 0.00 -0.26 0.00 0.00 58.87 55.31 2ksm n SER 137 Cb 1.77 -0.56 0.08 0.00 -0.26 0.00 0.00 64.21 65.24 2ksm n SER 137 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ksm h ALA 138 N 1.56 0.79 0.21 7.33 0.00 0.32 -3.26 119.26 126.21 2ksm h ALA 138 Ca 0.30 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2ksm h ALA 138 Cb 1.43 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 19.19 2ksm h ALA 138 CO 0.64 0.16 -0.50 0.93 0.00 0.00 0.00 179.25 180.49 2ksm h GLU 139 N 0.00 -0.75 -1.00 0.00 3.07 -1.80 1.98 114.58 116.08 2ksm h GLU 139 Ca -0.01 0.05 0.04 0.00 -0.50 0.00 0.00 59.36 58.94 2ksm h GLU 139 Cb 1.10 0.17 -0.06 0.00 -0.84 0.00 0.00 28.75 29.12 2ksm h GLU 139 CO 0.01 -0.50 0.65 -1.00 -1.40 0.00 0.00 179.01 176.78 2ksm h PRO 140 N -0.78 1.22 0.17 2.33 0.13 -1.94 0.13 132.00 133.26 2ksm h PRO 140 Ca -0.02 -0.07 -0.01 0.00 -0.87 0.00 0.00 66.00 65.03 2ksm h PRO 140 Cb 0.75 -0.28 0.00 0.00 0.13 0.00 0.00 31.00 31.60 2ksm h PRO 140 CO -0.22 0.81 -0.08 0.28 -0.23 0.00 0.00 178.00 178.56 2ksm h VAL 141 N 1.26 0.00 -1.01 1.56 2.07 -1.40 -2.42 116.25 116.31 2ksm h VAL 141 Ca 0.40 -0.20 0.24 0.00 0.82 0.00 0.00 66.70 67.96 2ksm h VAL 141 Cb 0.01 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 29.66 2ksm h VAL 141 CO -0.13 0.00 0.61 0.15 0.02 0.00 0.00 177.57 178.22 2ksm h PHE 142 N -0.42 0.98 0.00 1.57 3.57 0.31 1.08 116.94 124.03 2ksm h PHE 142 Ca -0.02 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.47 2ksm h PHE 142 Cb 0.17 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.62 2ksm h PHE 142 CO 0.07 0.07 -0.20 1.79 -2.23 0.00 0.00 178.31 177.81 2ksm h THR 143 N 0.57 1.03 0.00 4.41 1.35 -0.80 0.38 112.91 119.85 2ksm h THR 143 Ca 0.64 -0.71 0.00 0.00 -0.55 0.00 0.00 66.41 65.78 2ksm h THR 143 Cb 1.24 1.40 0.00 0.00 -1.73 0.00 0.00 68.15 69.06 2ksm h THR 143 CO -0.45 0.20 0.00 0.00 -0.25 0.00 0.00 175.52 175.02 2ksm h ALA 144 N 1.80 1.00 -0.11 6.62 0.00 0.17 -2.55 119.26 126.20 2ksm h ALA 144 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2ksm h ALA 144 Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2ksm h ALA 144 CO 0.03 0.00 0.00 0.45 0.00 0.00 0.00 179.25 179.73 2ksm n SER 145 N -2.64 2.17 -0.06 0.00 2.88 -0.06 -4.68 113.62 111.23 2ksm n SER 145 Ca 0.02 -1.61 -0.08 0.00 -1.33 0.00 0.00 58.87 55.88 2ksm n SER 145 Cb 0.29 -0.07 -0.01 0.00 -0.75 0.00 0.00 64.21 63.67 2ksm n SER 145 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 2ksm h VAL 146 N 2.01 0.82 0.00 2.46 2.07 -0.60 -1.66 116.25 121.35 2ksm h VAL 146 Ca 0.00 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.50 2ksm h VAL 146 Cb 0.52 0.74 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 2ksm h VAL 146 CO 0.00 0.01 0.00 -0.81 0.02 0.00 0.00 177.57 176.79 2ksm n PRO 147 N -5.15 0.21 -3.41 1.57 -0.04 -1.26 -3.86 135.00 123.06 2ksm n PRO 147 Ca -0.01 0.00 -0.26 0.00 -0.04 0.00 0.00 63.50 63.19 2ksm n PRO 147 Cb 0.13 -1.08 -0.10 0.00 -0.04 0.00 0.00 33.50 32.40 2ksm n PRO 147 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2ksm s ILE 148 N -1.19 0.07 -1.51 0.52 1.01 -0.63 -4.98 121.20 114.49 2ksm s ILE 148 Ca 0.00 -1.78 0.00 0.00 0.00 0.00 0.00 60.65 58.87 2ksm s ILE 148 Cb 0.00 -1.03 0.00 0.00 0.01 0.00 0.00 42.46 41.44 2ksm s ILE 148 CO 0.00 -0.95 0.71 -0.81 0.00 0.00 0.00 174.94 173.89 2ksm n PRO 149 N 3.76 0.94 -0.93 2.79 -0.04 -1.25 -3.12 135.00 137.15 2ksm n PRO 149 Ca 0.16 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.63 2ksm n PRO 149 Cb 0.42 -1.23 0.16 0.00 -0.04 0.00 0.00 33.50 32.81 2ksm n PRO 149 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2ksm n ASP 150 N -0.24 2.23 -4.92 3.54 8.00 -1.10 -1.27 116.55 122.79 2ksm n ASP 150 Ca 0.00 -3.75 -0.26 0.00 0.71 0.00 0.00 54.79 51.49 2ksm n ASP 150 Cb 0.11 -0.48 -0.03 0.00 -0.02 0.00 0.00 41.12 40.70 2ksm n ASP 150 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2ksm s PHE 151 N -3.13 3.44 0.01 1.24 0.40 -0.95 -3.46 117.98 115.53 2ksm s PHE 151 Ca 0.40 0.10 0.06 0.00 -0.60 0.00 0.00 56.93 56.89 2ksm s PHE 151 Cb 0.38 -1.65 -0.02 0.00 0.51 0.00 0.00 43.02 42.24 2ksm s PHE 151 CO -0.06 0.52 -0.20 0.20 0.70 0.00 0.00 175.22 176.38 2ksm s GLY 152 N -3.21 1.02 -0.09 4.36 0.00 -0.09 -2.64 107.32 106.66 2ksm s GLY 152 Ca 0.34 -0.92 0.00 0.00 0.00 0.00 0.00 44.72 44.14 2ksm s GLY 152 CO 0.28 -0.80 -0.08 -2.27 0.00 0.00 0.00 173.10 170.22 2ksm s LEU 153 N -0.72 1.28 -0.05 0.66 1.98 -0.97 -3.04 118.68 117.82 2ksm s LEU 153 Ca 0.07 -0.28 0.01 0.00 -2.89 0.00 0.00 54.13 51.04 2ksm s LEU 153 Cb -0.08 -0.79 0.02 0.00 0.66 0.00 0.00 46.19 46.00 2ksm s LEU 153 CO 0.00 -0.08 -0.04 -0.75 -1.89 0.00 0.00 176.35 173.59 2ksm s LYS 154 N 1.41 0.83 -0.06 1.98 2.20 -1.09 -1.47 119.74 123.54 2ksm s LYS 154 Ca -0.01 -0.10 0.05 0.00 -0.36 0.00 0.00 55.97 55.55 2ksm s LYS 154 Cb -0.13 -0.85 -0.02 0.00 -1.51 0.00 0.00 37.83 35.31 2ksm s LYS 154 CO -0.05 -0.09 -0.20 0.08 -0.36 0.00 0.00 175.35 174.73 2ksm s VAL 155 N 0.98 2.56 0.00 4.02 1.01 -0.98 -0.94 120.40 127.05 2ksm s VAL 155 Ca -0.10 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 60.98 2ksm s VAL 155 Cb -0.14 -1.97 0.00 0.00 0.00 0.00 0.00 36.38 34.27 2ksm s VAL 155 CO -0.00 0.57 0.00 1.21 0.00 0.00 0.00 175.10 176.88 2ksm n GLU 156 N 2.67 3.95 0.05 2.72 2.13 0.86 -1.04 120.64 131.98 2ksm n GLU 156 Ca -0.17 0.00 -0.03 0.00 0.66 0.00 0.00 57.16 57.62 2ksm n GLU 156 Cb 0.52 0.00 -0.01 0.00 0.27 0.00 0.00 31.44 32.22 2ksm n GLU 156 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2ksm h ARG 157 N 0.00 -0.16 -0.02 5.31 3.08 -1.99 -3.40 114.38 117.20 2ksm h ARG 157 Ca 0.00 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.06 2ksm h ARG 157 Cb 0.00 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.09 2ksm h ARG 157 CO 0.00 -0.11 0.00 -0.40 -1.07 0.00 0.00 179.97 178.39 2ksm n ASP 158 N -3.01 2.07 -4.34 7.04 5.75 -1.26 -4.67 116.55 118.12 2ksm n ASP 158 Ca -0.02 -2.03 -0.18 0.00 -0.01 0.00 0.00 54.79 52.55 2ksm n ASP 158 Cb 0.06 -0.03 -0.10 0.00 -1.03 0.00 0.00 41.12 40.03 2ksm n ASP 158 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2ksm s THR 159 N -1.06 1.59 -0.04 2.12 2.01 -1.26 -4.27 115.64 114.74 2ksm s THR 159 Ca 0.02 -2.17 0.00 0.00 0.31 0.00 0.00 61.69 59.86 2ksm s THR 159 Cb 0.02 -2.09 0.03 0.00 0.01 0.00 0.00 72.50 70.46 2ksm s THR 159 CO 0.01 -0.56 -0.01 -0.69 -0.69 0.00 0.00 174.62 172.68 2ksm s VAL 160 N -3.06 0.30 0.04 3.82 1.01 -0.07 -0.10 120.40 122.33 2ksm s VAL 160 Ca 0.23 0.04 0.05 0.00 0.00 0.00 0.00 61.98 62.30 2ksm s VAL 160 Cb 0.01 -0.38 -0.03 0.00 0.00 0.00 0.00 36.38 35.97 2ksm s VAL 160 CO 0.07 0.18 -0.10 0.42 0.00 0.00 0.00 175.10 175.67 2ksm s THR 161 N 1.13 3.38 -0.10 3.92 -4.23 -0.11 -2.74 115.64 116.89 2ksm s THR 161 Ca -0.08 -0.99 0.01 0.00 -1.18 0.00 0.00 61.69 59.45 2ksm s THR 161 Cb -0.14 -2.49 0.02 0.00 1.34 0.00 0.00 72.50 71.23 2ksm s THR 161 CO -0.02 0.31 -0.11 -0.22 -0.54 0.00 0.00 174.62 174.04 2ksm s LEU 162 N -1.62 1.50 -0.07 4.79 0.20 -0.89 -2.69 118.68 119.91 2ksm s LEU 162 Ca 0.18 -0.34 -0.03 0.00 0.69 0.00 0.00 54.13 54.62 2ksm s LEU 162 Cb -0.11 -0.92 0.04 0.00 -0.43 0.00 0.00 46.19 44.77 2ksm s LEU 162 CO 0.09 -0.03 0.14 0.42 -0.29 0.00 0.00 176.35 176.68 2ksm s THR 163 N 1.17 -0.07 -0.21 3.68 -4.23 -1.17 -1.24 115.64 113.58 2ksm s THR 163 Ca -0.04 0.20 -0.22 0.00 -1.18 0.00 0.00 61.69 60.45 2ksm s THR 163 Cb -0.14 -0.24 0.06 0.00 1.34 0.00 0.00 72.50 73.52 2ksm s THR 163 CO -0.03 0.08 0.61 -0.83 -0.54 0.00 0.00 174.62 173.91 2ksm s GLY 164 N 1.26 -0.46 -0.19 3.99 0.00 -1.26 -0.91 107.32 109.75 2ksm s GLY 164 Ca -0.08 1.64 -0.29 0.00 0.00 0.00 0.00 44.72 45.99 2ksm s GLY 164 CO -0.06 1.40 1.48 -1.59 0.00 0.00 0.00 173.10 174.33 2ksm s THR 165 N 0.16 3.90 -0.44 0.90 2.01 -1.22 -4.23 115.64 116.71 2ksm s THR 165 Ca -0.01 1.04 0.02 0.00 0.31 0.00 0.00 61.69 63.05 2ksm s THR 165 Cb -0.04 -3.81 0.15 0.00 0.01 0.00 0.00 72.50 68.81 2ksm s THR 165 CO 0.02 -0.25 0.29 0.00 -0.69 0.00 0.00 174.62 173.99 2ksm s ALA 166 N 4.42 1.77 -0.99 7.40 0.00 -1.23 -4.88 121.76 128.26 2ksm s ALA 166 Ca 0.65 -2.49 0.00 0.00 0.00 0.00 0.00 51.96 50.12 2ksm s ALA 166 Cb -0.24 -1.75 0.00 0.00 0.00 0.00 0.00 23.12 21.13 2ksm s ALA 166 CO 0.25 -2.05 0.35 -2.30 0.00 0.00 0.00 175.76 172.01 2ksm n PRO 167 N 3.30 0.00 0.00 0.00 -0.02 -1.26 -4.20 135.00 132.82 2ksm n PRO 167 Ca 0.17 0.05 0.00 0.00 -2.02 0.00 0.00 63.50 61.70 2ksm n PRO 167 Cb 0.39 -1.54 0.00 0.00 -0.02 0.00 0.00 33.50 32.33 2ksm n PRO 167 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2ksm n SER 168 N -0.85 0.00 0.00 2.55 2.88 -1.26 -4.67 113.62 112.27 2ksm n SER 168 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2ksm n SER 168 Cb 0.04 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.50 2ksm n SER 168 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2ksm n SER 169 N 0.00 0.00 0.20 -3.46 3.41 -1.26 -4.89 113.62 107.61 2ksm n SER 169 Ca 0.00 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.74 2ksm n SER 169 Cb 0.00 0.00 0.43 0.00 -0.26 0.00 0.00 64.21 64.38 2ksm n SER 169 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2ksm h GLU 170 N 0.00 0.00 -0.54 4.33 4.39 -2.00 0.56 114.58 121.31 2ksm h GLU 170 Ca 0.00 0.00 0.16 0.00 0.34 0.00 0.00 59.36 59.86 2ksm h GLU 170 Cb 0.00 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.63 2ksm h GLU 170 CO 0.00 0.00 0.81 0.45 -1.16 0.00 0.00 179.01 179.11 2ksm h HIS 171 N 0.00 0.00 0.00 4.33 3.86 -1.96 1.83 115.15 123.22 2ksm h HIS 171 Ca 0.12 0.00 -0.15 0.00 -1.16 0.00 0.00 60.37 59.18 2ksm h HIS 171 Cb 1.65 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 30.10 2ksm h HIS 171 CO 0.00 0.00 -0.84 1.57 0.86 0.00 0.00 177.93 179.52 2ksm h LYS 172 N 0.00 0.00 0.16 2.45 2.10 -1.28 -3.34 116.57 116.66 2ksm h LYS 172 Ca 0.26 0.00 0.01 0.00 -2.00 0.00 0.00 60.65 58.92 2ksm h LYS 172 Cb 1.87 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 33.15 2ksm h LYS 172 CO -0.00 0.56 -0.45 0.22 -2.00 0.00 0.00 179.45 177.78 2ksm h ASP 173 N 0.00 -1.32 -0.56 7.07 1.82 0.27 0.49 116.42 124.19 2ksm h ASP 173 Ca -0.05 0.14 0.03 0.00 -0.39 0.00 0.00 57.03 56.76 2ksm h ASP 173 Cb 1.53 0.49 -0.04 0.00 0.68 0.00 0.00 39.33 41.99 2ksm h ASP 173 CO 0.07 -0.52 0.33 0.00 -1.61 0.00 0.00 179.24 177.51 2ksm h ALA 174 N -0.32 0.73 -0.40 -0.78 0.00 -1.71 0.47 119.26 117.25 2ksm h ALA 174 Ca 0.01 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2ksm h ALA 174 Cb 0.72 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 2ksm h ALA 174 CO -0.23 0.03 0.19 0.28 0.00 0.00 0.00 179.25 179.52 2ksm h VAL 175 N 0.64 1.18 -0.19 0.00 2.07 -1.58 0.31 116.25 118.69 2ksm h VAL 175 Ca 0.23 -0.50 -0.05 0.00 0.82 0.00 0.00 66.70 67.20 2ksm h VAL 175 Cb 0.06 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 2ksm h VAL 175 CO -0.12 0.19 -0.06 0.50 0.02 0.00 0.00 177.57 178.10 2ksm h LYS 176 N 0.51 0.37 -0.80 1.57 3.64 0.38 -0.15 116.57 122.09 2ksm h LYS 176 Ca 0.14 -0.15 0.04 0.00 -1.27 0.00 0.00 60.65 59.40 2ksm h LYS 176 Cb 0.12 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 31.88 2ksm h LYS 176 CO -0.02 0.65 0.51 -0.09 -2.27 0.00 0.00 179.45 178.23 2ksm h ARG 177 N 0.08 0.96 -0.29 1.90 2.43 0.03 0.64 114.38 120.12 2ksm h ARG 177 Ca 0.05 -0.06 -0.07 0.00 -0.81 0.00 0.00 59.98 59.08 2ksm h ARG 177 Cb 0.52 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.85 2ksm h ARG 177 CO 0.02 0.63 -0.11 0.00 -1.51 0.00 0.00 179.97 179.01 2ksm h ALA 178 N 1.34 0.41 -0.14 2.80 0.00 -0.85 -2.04 119.26 120.78 2ksm h ALA 178 Ca 0.33 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 2ksm h ALA 178 Cb 0.03 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 2ksm h ALA 178 CO -0.12 0.27 -0.03 0.00 0.00 0.00 0.00 179.25 179.37 2ksm h ALA 179 N 0.77 0.20 -0.52 0.00 0.00 -0.54 -2.76 119.26 116.40 2ksm h ALA 179 Ca 0.07 -0.22 0.06 0.00 0.00 0.00 0.00 54.91 54.82 2ksm h ALA 179 Cb 0.61 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 2ksm h ALA 179 CO 0.04 -0.07 0.22 1.79 0.00 0.00 0.00 179.25 181.23 2ksm h THR 180 N -0.03 0.88 0.00 0.00 1.35 0.25 0.14 112.91 115.50 2ksm h THR 180 Ca 0.04 -0.15 -0.01 0.00 -0.55 0.00 0.00 66.41 65.74 2ksm h THR 180 Cb 0.44 0.41 -0.00 0.00 -1.73 0.00 0.00 68.15 67.27 2ksm h THR 180 CO 0.01 0.08 -0.05 0.77 -0.25 0.00 0.00 175.52 176.08 2ksm h SER 181 N 0.43 0.00 0.80 5.36 4.64 -1.34 0.21 113.55 123.65 2ksm h SER 181 Ca 0.24 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.35 2ksm h SER 181 Cb 0.22 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.27 2ksm h SER 181 CO -0.21 0.05 -1.31 0.71 -0.87 0.00 0.00 176.83 175.20 2ksm h THR 182 N 0.00 0.95 -2.02 2.95 1.35 -0.67 -3.40 112.91 112.07 2ksm h THR 182 Ca -0.00 -2.61 -0.54 0.00 -0.55 0.00 0.00 66.41 62.71 2ksm h THR 182 Cb 0.16 2.41 -0.40 0.00 -1.73 0.00 0.00 68.15 68.60 2ksm h THR 182 CO 0.01 0.54 -1.09 0.79 -0.25 0.00 0.00 175.52 175.52 2ksm n TRP 183 N -3.10 0.21 0.09 4.73 8.01 0.27 -4.96 117.44 122.70 2ksm n TRP 183 Ca -0.09 -3.69 -0.13 0.00 -1.31 0.00 0.00 57.50 52.28 2ksm n TRP 183 Cb 0.93 -0.39 -0.09 0.00 -2.01 0.00 0.00 31.31 29.74 2ksm n TRP 183 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 2ksm h PRO 184 N 3.69 0.27 -0.00 -0.99 0.13 -0.84 -3.25 132.00 131.01 2ksm h PRO 184 Ca 0.09 -0.38 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 2ksm h PRO 184 Cb 0.88 0.13 0.00 0.00 0.13 0.00 0.00 31.00 32.14 2ksm h PRO 184 CO 0.51 1.13 -0.00 -0.25 -0.23 0.00 0.00 178.00 179.16 2ksm n ASP 185 N -3.59 0.34 -4.40 1.44 8.00 -1.26 -4.74 116.55 112.35 2ksm n ASP 185 Ca -0.07 -1.09 -0.33 0.00 0.71 0.00 0.00 54.79 54.01 2ksm n ASP 185 Cb 0.94 -0.01 -0.14 0.00 -0.02 0.00 0.00 41.12 41.89 2ksm n ASP 185 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 2ksm s MET 186 N -2.02 3.46 -0.37 -1.24 -1.94 -1.23 -5.04 119.30 110.92 2ksm s MET 186 Ca 0.45 -0.64 -0.38 0.00 -1.71 0.00 0.00 55.69 53.41 2ksm s MET 186 Cb 0.22 -2.73 -0.14 0.00 2.01 0.00 0.00 34.83 34.19 2ksm s MET 186 CO 0.37 0.19 2.10 1.63 -0.01 0.00 0.00 175.02 179.30 2ksm n LYS 187 N 3.62 0.83 -3.97 2.03 4.76 -1.26 -4.76 118.16 119.41 2ksm n LYS 187 Ca -0.18 0.24 -0.34 0.00 -2.87 0.00 0.00 58.31 55.16 2ksm n LYS 187 Cb 0.52 -2.17 -0.15 0.00 -1.84 0.00 0.00 35.03 31.40 2ksm n LYS 187 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2ksm s ILE 188 N 6.36 2.98 -0.29 -0.18 -1.09 -1.26 -0.90 121.20 126.83 2ksm s ILE 188 Ca 1.10 -0.69 0.01 0.00 -2.23 0.00 0.00 60.65 58.84 2ksm s ILE 188 Cb -1.05 -2.36 0.09 0.00 -1.58 0.00 0.00 42.46 37.56 2ksm s ILE 188 CO 0.56 0.41 0.04 0.54 -1.23 0.00 0.00 174.94 175.26 2ksm s VAL 189 N 1.41 1.40 -0.50 2.92 0.11 -1.11 -5.04 120.40 119.59 2ksm s VAL 189 Ca 0.05 -1.55 -0.18 0.00 -2.93 0.00 0.00 61.98 57.37 2ksm s VAL 189 Cb -0.14 -1.93 0.06 0.00 -1.53 0.00 0.00 36.38 32.84 2ksm s VAL 189 CO -0.06 -0.47 0.58 0.20 -3.33 0.00 0.00 175.10 172.02 2ksm s ASN 190 N 1.38 6.21 -0.59 3.54 -0.87 -1.26 -2.10 114.94 121.25 2ksm s ASN 190 Ca 0.05 -1.03 0.02 0.00 -1.57 0.00 0.00 52.86 50.33 2ksm s ASN 190 Cb -0.18 -2.27 0.15 0.00 -0.02 0.00 0.00 41.25 38.93 2ksm s ASN 190 CO -0.14 -0.85 0.37 0.54 -2.57 0.00 0.00 177.10 174.44 2ksm s ASN 191 N 2.73 4.72 0.06 -1.22 2.20 -0.37 -4.98 114.94 118.08 2ksm s ASN 191 Ca 0.12 -3.11 -0.03 0.00 -0.94 0.00 0.00 52.86 48.90 2ksm s ASN 191 Cb -0.21 -1.72 -0.05 0.00 -2.00 0.00 0.00 41.25 37.28 2ksm s ASN 191 CO 0.10 -0.25 0.27 0.27 -2.94 0.00 0.00 177.10 174.55 2ksm s ILE 192 N -0.43 5.31 0.31 0.54 -4.36 -1.26 -4.59 121.20 116.72 2ksm s ILE 192 Ca 0.18 -0.09 0.08 0.00 -0.26 0.00 0.00 60.65 60.56 2ksm s ILE 192 Cb -0.21 -3.60 -0.03 0.00 1.25 0.00 0.00 42.46 39.87 2ksm s ILE 192 CO -0.03 0.20 0.22 -1.61 0.24 0.00 0.00 174.94 173.96 2ksm s GLU 193 N -2.26 2.69 -0.18 0.37 2.02 -1.26 -5.01 118.70 115.07 2ksm s GLU 193 Ca 0.33 -1.28 -0.00 0.00 0.02 0.00 0.00 54.97 54.04 2ksm s GLU 193 Cb -0.13 -2.43 0.00 0.00 0.10 0.00 0.00 34.13 31.68 2ksm s GLU 193 CO 0.23 0.20 -0.14 0.14 0.02 0.00 0.00 175.26 175.70 2ksm s VAL 194 N -2.28 2.64 -0.24 2.63 -7.23 -1.26 -3.49 120.40 111.16 2ksm s VAL 194 Ca 0.38 -0.76 -0.28 0.00 -1.81 0.00 0.00 61.98 59.50 2ksm s VAL 194 Cb -0.06 -2.13 -0.04 0.00 0.56 0.00 0.00 36.38 34.71 2ksm s VAL 194 CO 0.25 0.50 2.00 0.42 -0.31 0.00 0.00 175.10 177.96 2ksm s THR 195 N 1.11 3.24 0.04 5.32 -4.23 -1.26 -4.42 115.64 115.44 2ksm s THR 195 Ca 0.00 0.25 0.00 0.00 -1.18 0.00 0.00 61.69 60.76 2ksm s THR 195 Cb -0.14 -3.30 0.00 0.00 1.34 0.00 0.00 72.50 70.40 2ksm s THR 195 CO -0.05 -0.17 0.00 0.61 -0.54 0.00 0.00 174.62 174.47 2ksm n GLY 196 N 5.44 -1.91 0.42 3.99 0.00 -1.26 -4.91 105.19 106.97 2ksm n GLY 196 Ca 0.26 0.53 0.22 0.00 0.00 0.00 0.00 46.02 47.02 2ksm n GLY 196 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2ksm h GLN 197 N 0.00 0.00 -7.38 1.61 5.75 -2.06 -3.40 115.11 109.63 2ksm h GLN 197 Ca 0.00 0.00 -0.50 0.00 -0.15 0.00 0.00 58.65 58.00 2ksm h GLN 197 Cb 0.00 0.00 0.09 0.00 1.07 0.00 0.00 27.48 28.64 2ksm h GLN 197 CO 0.00 0.00 0.37 0.00 -2.65 0.00 0.00 178.83 176.55 2ksm s ALA 198 N -4.52 2.64 0.77 3.38 0.00 -1.26 -5.04 121.76 117.73 2ksm s ALA 198 Ca -0.04 -0.07 -0.11 0.00 0.00 0.00 0.00 51.96 51.75 2ksm s ALA 198 Cb 0.14 -3.13 0.05 0.00 0.00 0.00 0.00 23.12 20.19 2ksm s ALA 198 CO 0.50 -1.28 1.08 -1.25 0.00 0.00 0.00 175.76 174.81 2ksm s PRO 199 N -5.13 2.29 -0.94 0.00 0.04 -1.26 -4.82 135.00 125.18 2ksm s PRO 199 Ca 0.58 0.98 -0.32 0.00 0.04 0.00 0.00 61.00 62.28 2ksm s PRO 199 Cb -0.13 -1.91 -0.22 0.00 0.04 0.00 0.00 34.50 32.28 2ksm s PRO 199 CO 0.54 -1.57 2.64 -2.30 0.04 0.00 0.00 177.00 176.35 2ksm n PRO 200 N -3.45 0.01 -2.27 0.56 -0.02 -1.26 -4.90 135.00 123.67 2ksm n PRO 200 Ca 0.08 0.00 -0.20 0.00 -2.02 0.00 0.00 63.50 61.36 2ksm n PRO 200 Cb 0.54 -1.52 0.11 0.00 -0.02 0.00 0.00 33.50 32.61 2ksm n PRO 200 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ksm n GLY 201 N 6.61 0.52 3.32 -1.23 0.00 -1.26 -5.05 105.19 108.10 2ksm n GLY 201 Ca 0.65 -2.00 -0.34 0.00 0.00 0.00 0.00 46.02 44.32 2ksm n GLY 201 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2ksm n PRO 202 N -2.67 -0.10 0.00 1.61 -0.02 -1.26 -5.25 135.00 127.31 2ksm n PRO 202 Ca 0.14 0.00 0.08 0.00 -2.02 0.00 0.00 63.50 61.71 2ksm n PRO 202 Cb 0.51 -1.62 0.50 0.00 -0.02 0.00 0.00 33.50 32.87 2ksm n PRO 202 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13